期刊名称：COMPUTER PHYSICS COMMUNICATIONS
 期刊简介(About the journal)
投稿须知(Instructions to Authors)
编辑部信息(Editorial Board)
About the journal
Computer Physics Communications (CPC) publishes research papers in computational physics and physical
chemistry, and closely related areas in computational science, computer programs, review articles on selected topics, proceedings of topical conferences in the field, thematic issues, and comments on previous publications in the journal. All contributions are handled by an international board of experts covering all subfields of computational physics and physical chemistry. Computer programs are deposited in the CPC Program Library, and a description is published as an article in the journal.
Articles cover:
Computational models in Physics and Physical Chemistry;
Computer programs in Physics and Physical Chemistry;
Computational models and programs associated with the design, control, and analysis of experiments;
Numerical methods and algorithms;
Algebraic computation;
Impact of advanced computer architecture and special purpose computers on computing in the Physical Sciences;
Software topics, including programming environments, languages, data bases, expert systems, and graphics packages related to Physical Sciences;
Analysis of computer systems performance.
A subscription to Computer Physics Communications now also includes access to the full Program Library. Details are available on the CPC Program Library WWW home page at: http://www.cpc.cs.qub.ac.uk/cpc/ and also appeared in the January 1996 issue.
To ensure that your subscribing library has registered access to the CPC Program Library, you are invited to complete the Guest Book at the CPC home page above.
Instructions to Authors
Submission of papers
Manuscripts (three copies, including hardcopies of illustrations in each), accompanied by a covering letter, should be sent to one of the Principal Editors or Editors in Specialist Fields.
Original material. By submitting a paper for publication in Computer Physics Communications the authors imply that the material has not been published previously nor has been submitted for publication elsewhere and that the authors have obtained the necessary authority for publication.
Refereeing. Submitted papers will be refereed and, if necessary, authors may be invited to revise their manuscript. If a submitted paper relies heavily on unpublished material (e.g., a paper in press), it would be helpful to have a copy of that material for the use of the referee.
Types of contributions
Computer Physics Communications publishes several types of papers:
Regular articles. These are research papers in any area of computational physics or computational physical chemistry;
Computer program descriptions of new or revised programs to be placed in the CPC Program Library. These are full papers on new programs or new versions of programs. (A description of the CPC Program Library is available at http://www.cpc.cs.qub.ac.uk)
Features articles. These articles are usually arranged by invitation from the editors, and they provide a review of a body of work in a subfield of computational physics or physical chemistry or an overview of a body of the author?s own work;
New version announcements. These describe new versions of programs but are much shorter than full papers on new versions;
Errata;
Book reviews
Manuscript preparation
All manuscripts should be written in English. The paper copies of the text should be prepared with double line spacing and wide margins, on numbered sheets. Also note details on electronic version of manuscripts.
Structure. Please adhere to the following order of presentation:
Article title
Author(s)
Affiliation(s)
Abstract
PACS codes and keywords
Program summary*
Main text
Acknowledgements
Appendices
References
Test Run Input* and Output*
Figure Captions
Tables
(Items marked with * are only required for program descriptions; see more detailed instructions to Authors)
Corresponding author. The name, complete postal address, telephone and fax numbers and the email address of the corresponding author should be given on the first page of the manuscript.
PACS codes/keywords. Please supply one to four PACS classification codes and 5-8 keywords of your own choice for indexing purposes. A complete list of PACS codes is available at http://www.elsevier.nl/locate/pacs
References. References to other work should be consecutively numbered in the text using square brackets and listed by number in the Reference list. An example is given in the more detailed instructions to Authors).
Illustrations
Illustrations should also be submitted in triplicate: one master set and two sets of copies. The line drawings in the master set should be original laser printer or plotter output or drawn in black india ink, with careful lettering, large enough (3-5mm) to remain legible after reduction for printing. The photographs should be originals, with somewhat more contrast than is required in the printed version. They should be unmounted unless part of a composite figure. Any scale markers should be inserted on the photograph, not drawn below it.
Colour plates. Figures may be published in colour, if this is judged essential by the Editor. The Publisher and the author will each bear part of the extra costs involved. Further information is available from the Publisher.
Also note details on electronic version of manuscripts.
After acceptanceNotification. You will be notified by the Editor of the journal of the acceptance of your article. You will be invited to supply an electronic version of the accepted text, if this is not already available.
Copyright transfer. You will be asked to transfer the copyright of the article to the Publisher. This transfer will ensure the widest possible dissemination of information.
Computer programs. After acceptance of the description of a computer program, you will be asked to send the program file to the CPC Program Library.
Electronic manuscripts and Figures
The Publisher welcomes the receipt of an electronic version of your accepted manuscript (preferably encoded in LaTeX). If you have not already supplied the final, revised version of your article (on diskette) to the Journal Editor, you are requested herewith to send a file with the text of the accepted manuscript directly to the Publisher by email or on diskette (allowed formats 3.5" or 5.25" MS-DOS or 3.5" Macintosh) to the address given below. Please note that no deviations from the version accepted by the Editor of the journal are permissible without prior and explicit approval by the Editor. Such changes should be clearly indicated on an accompanying printout of the file.
The Elsevier LaTeX package (including detailed instructions for LaTeX preparation) may be downloaded from one of the following participating hosts in the Comprehensive TeX Archive Network (CTAN). Select the one in closest network proximity to you:
German Language TeX Users' Group, Heidelberg (Germany)
University of Cambridge Computer Lab (United Kingdom)
Sam Houston State University, Texas (United States)
Alternatively use anonymous FTP to one of the following sites
ftp.dante.de
ftp.tex.ac.uk
ftp.shsu.edu
and obtain the files from the directory /tex-archive/macros/latex/contrib/supported/elsevier
For a list of sites maintaining a (partial) mirror of the CTAN archive see German Language TeX Users' Group, Heidelberg (Germany), University of Cambridge Computer Lab (United Kingdom) or Sam Houston State University, Texas (United States).
Alternatively, if you wish to obtain a copy of the CTAN via CD-ROM see German Language TeX Users' Group, Heidelberg (Germany), University of Cambridge Computer Lab (United Kingdom) or Sam Houston State University, Texas (United States) for details.
The Elsevier package consists of the following files:
- ascii.tab (ASCII table)
- elsart.cls (use this file if you are using LaTeX2e, the current version of LaTeX)
- elsart.sty and elsart12.sty (use these two files if you are using LaTeX2.09, the previous version of LaTeX)
- instraut.dvi and/or instraut.ps (instruction booklet)
- readme
Questions concerning the LaTeX author-prepared article project and requests for the booklet with instructions to authors should be directed to the address below.
If sent via electronic mail, files should be accompanied by a clear identification of the article (name of journal, editor's reference number) in the "subject field" of the electronic mail message. An ASCII table (available from the publisher) should be included in the files, to enable any transmission errors to be detected.
Submission of Electronic figures is encouraged. Detailed guidelines on how to prepare your artwork for electronic submission including common problems, suggestions on how to ensure the best results and guidelines for popular applications can be obtained from the Elsevier electronic artwork site.
Author benefits
No page charges. Publishing in Computer Physics Communications is free.
Free Offprints. The corresponding author will receive 25 offprints free of charge. An offprint order form will be supplied by the Publisher for ordering any additional paid offprints.
Discount. Contributors to Elsevier Science journals are entitled to a 30% discount on all Elsevier Science books, except for major reference works
Contents Alert. Papers scheduled for publication in Computer Physics Communications are included in Elsevier's pre-publication service Contents Alert. (for information, please contact: C-alert.mathphys@elsevier.nl
ContentsDirect: Free e-mail service ContentsDirect. Register at http://www.elsevier.nl/locate/ContentsDirect
Further information (after acceptance)
E-mail: authorsupport@elsevier.ie
Editorial Board
- Honorary Editor
- P.G. Burke, Department of Applied Mathematics and Theoretical Physics, The Queen's University of Belfast, Belfast BT7 INN, Northern Ireland, UK
- Principal Editors
- J.W. Eastwood, Culham Laboratory, Abingdon, Oxfordshire OX14 3DB, UK Email: jwe@edit-cpc.demon.co.uk
J.E. Inglesfield, Dept. of Physics and Astronomy, University of Wales College of Cardiff, PO Box 913, Cardiff CF2 3YB, UK Email: john.inglesfield@astro.cf.ac.uk
F. James, CERN, Data Handling Division, CH-1211 Geneva 23, Switzerland Email: f.james@cern.ch
D.P. Landau, Center for Simulation Physics, The University of Georgia, Athens, GA 30602, USA. Tel: +1-7065422908, Fax: 1-7065422908, Email: dlandau@hal.physast.uga.edu
P.R. Taylor, Centre for Scientific Computing, University of Warwick, Coventry CV4 7AL, UK Email: p.r.taylor@warwick.ac.uk
D.G. Truhlar, University of Minnesota, Dept. of Chemistry and Supercomputer Institute, 207 Pleasant Street S.E., Minneapolis, MN 55455, USA Email: truhlar@chem.umn.edu
- Program Librarian
- C. Jackson, Department of Applied Mathematics and Theoretical Physics, The Queen's University of Belfast, Belfast BT7 INN, Northern Ireland, UK Email: cpc@qub.ac.uk
- Program Library Director Emeritus
- P.G. Burke, Department of Applied Mathematics and Theoretical Physics, The Queen's University of Belfast, Belfast BT7 INN, Northern Ireland, UK Email: cpc@qub.ac.uk
- Program Library Director
- N.S. Scott, School of Computer Science, The Queen's University of Belfast, Northern Ireland, UK
- Specialist Editors
- Algebraic Manipulation:
- E.S. Cheb-Terrab, Centre for Experimental and Constructive Mathematics, Simon-Fraser University, Vancouver, BC V5A 1S6, Canada Email: ecterrab@cecm.sfu.ca
R. Liska, Czech Technical University in Prague, Faculty of Nuc. Sci. and Phys. Eng., Brehova 7, 11519 Prague 1, Czech Republic Tel: +4202 2191 2272/2287, Fax: +4202 688 4818, Email: liska@siduri.fjfi.cvut.cz
T. Sturm, Universitat Passau, Fak. fur Math. und Informatik, Innstrasse 33, D-94030 Passau, Germany Tel: +0851 509 3124, Fax: +0851 509 3122, Email: sturm@uni-passau.de
- Algorithms, Software and Architectures:
- M. Arioli, Rutherford-Appleton Laboratory, Chilton, Didcot, Oxfordshire OX11 0QX, UK Tel: +44 1235 464371, Fax: +44 8700 553629, Email: m.arioli@rl.ac.uk
J.S. Kim, Pohang Univ. of Science and Tech., Department of Physics, Pohang, 790-784 South Korea Tel: +82 54 279 2077, Fax: +82 54 279 3099, Email: jsk@postech.ac.kr
W. Schonauer, Universitat Karlsruhe, Rechenzentrum Zirkel 2, Postfach 6380, D-76131 Karlsruhe, Germany Email: schoenauer@rz.uni-karlsruhe.de
N.S. Scott, School of Computer Science, The Queen's University of Belfast, Belfast BT7 INN, Northern Ireland, UK Email: ns.scott@qub.ac.uk
- Atomic and Molecular Dynamics and Spectra:
- G.B. Bacskay, University of Sydney, School of Chemistry, Bldg, F11, Sydney NSW 2006, Australia Tel: +61 2 9351 3777, Fax: +61 9351 3329, Email: bacskay@chem.usyd.edu.au
D.C. Clary, University College of London, Department of Chemistry, 20 Gordon Street, London, UK, WC1H 0AJ Tel: +44 20 7679 1488, Fax: +44 20 7679, Email: d.c.clary@ucl.ac.uk
G. Galli, Lawrence Livermore Nat. Laboratory, P.O.Box 808, L-407, Livermore 94551, USA Tel: +1 925 423 4223, Fax: +1 925 422 6594, Email: galligygi1@llnl.gov
F.A. Gianturco, Univ. d. Studi di Roma "La Sapienza", Dipartimento di Chimica, Citt?Universitaria, I-00185 Roma, Italy Email: fagiant@caspur.it
R. Kosloff, University of Jerusalem, Department of Physical Chemistry, 91904 Jerusalem, Israel Tel: +972 2 658 5485, Fax: +972 651 3742, Email: ronnie@fh.huji.ac.il
C. Leforestier, Universit?Montpellier II, LSDSMS, Batiment 15, CC 014, Place Eugene Bataillon, F-34095 Cedex 5, Montpellier, France Tel: +33 4 67 13 3339, Fax: +33 4 67 14 4839, Email: lefores@lsd.univ-montp2.fr
H. Nakamura, Inst. for Molecular Scienc, Myodaijii, Okazaki 444, Japan Tel: +81 564 54 1111, Fax: +81 564 54 2254, Email: nakamura@ims.ac.jp
C.J. Noble, Daresbury Laboratory, Dept. of Sci. and Eng. Computation, Daresbury, Warrington, Cheshire, UK, WA4 4AD Tel: +44 1925 603 340, Fax: +44 1925 603 634, Email: c.j.noble@dl.ac.uk
J.F. Reading, Texas A&M University, Department of Physics, College Station, TX 77843-4242, USA Tel: +1 409 845 5073, Email: reading@physics.tamu.edu
G.C. Schatz, Northwestern University, Department of Chemistry, 2145 Sheridan Road, Evanston, IL 60208-3113, USA Tel: +1 708 491 5657, Fax: +1 708 491 7713, Email: schatz@chem.nwu.edu
T. Seideman, Steacie Inst. for Molecular Sciences, Nat. Res. Council of Canada, 100 Sussex Drive, Ottawa, Ontario, Canada, K1A OR6 Tel: +1 613 990 0945, Fax: +1 613 947 2838, Email: tamar.seideman@nrc.ca
- Atomic and Molecular Structure and Properties:
- H. Agren, Royal Institute of Technology (KTH), Theoretical Chemistry, Teknikringen 30, S-10044 Stockholm, Sweden Tel: +46 8 790 8593, Fax: +46 8 790 8207, Email: agren@theochem.kth.se
G.B. Bacskay, University of Sidney, School of Chemistry, Bldg. F11, Sidney NSW 2006, Australia Email: bacskay@chem.usyd.edu.au
S. Canuto, University of Sao Paulo, Department of Physics, CP 66318, 05315-970 Sao Paulo, SP, Brazil Tel: +55 11 8186931, Email: canuto@if.usp.br
W. Duch, Nicholas Copernicus University, Department of Computer Methods, ul. Grudziadzka 5, 87-100 Torun, Poland Tel: +48 56 23267, Fax: +48 56 21543, Email: duch@phys.uni.torun.pl
A. Hibbert, The Queen's University of Belfast, Dept. Applied Mat. & Teor. Physics, Belfast, Northern Ireland, UK BT7 1NN Tel: +44 028 902 73 171, Fax: +44 028 902 39 182, Email: a.hibbert@qub.ac.uk
W.M. Klopper, Utrecht University, Debye Institute, P.O. Box 80 052, 3508 TB Utrecht, The Netherlands Tel: +31 30 253 41 44, Fax: +31 30 253 75 04, Email: w.m.klopper@chem.uu.nl
J.A. Nichols, Pacific Northwest National Lab., W.R. Wiley Environmental, Molecular Sciences Laboratory, P.O. Box 999, K1-96, Richland WA 99352, USA Tel: +1 509 372 4569, Fax: +1 509 375 6631, Email: jeff.nichols@pnl.gov
I. Shavitt, CLSL, Box 16-6, Department of Chemistry, University of Illinois, 600 St. Mathews Str., Urbana, IL 61801, USA Tel: +1 217 244 5384, Fax: +1 217 244 3186, Email: ishavitt@uiuc.edu
J.F. Stanton, University of Texas at Austin, Campus Mail Code: A5300, Austin TX 78712-1081, USA Tel: +1 512 471 5903/5864, Fax: +1 512 471 8696, Email: Jfstanton@mail.utexas.edu
- Biophysics and Biochemistry:
- M. Colvin, Lawrence Livermore Nat. Laboratory, Biology and Biotech Research Program, Mailstop L-452, Livermore, CA 94550, USA Tel: +1 925 423 9177, Fax: +1 925 424 4130, Email: colvin2@llnl.gov
M.J. Field, Institut de Biologie Structurale, Jean Pierre Ebel, Laboratoire de Dynamique Moleculaire, 41 rue Jules Horowitz, F-38027 Grenoble Cedex 1, France Tel: +33 4 76 88 95 94, Fax: +33 4 76 88 54 94, Email: mjfield@ibs.fr
B.M. Pettitt, University of Houston, Department of Chemistry, 4800 Calhoun Street, Houston, TX 77204-5641, USA Tel: +1 713 743 3263, Fax: +1 713 743 2709, Email: pettitt@uh.edu
J.C. Smith, Universitat Heidelberg, IWR, Im Neuenheimer Feld 368, D-69120 Heidelberg, Germany Tel: +49 6221 54 8857, Fax: +49 6221 54n8850, Email: biocomputing@iwr.uni-heidelberg.de
- Condensed Matter Physics:
- C.R.A. Catlow, Royal Institution of Great Britain, Davy Faraday Research Laboratory, 21 Albemarle Street, London W1X 4BS, UK Tel: +44 171 409 2992, Fax: +44 171 629 3569, Email: richard@ri.ac.uk
S. Crampin, University of Bath, Faculty of Science, Department of Physics, Claverton Down, Bath BA2 7AY, UK Tel: +44 1225 826826, Fax: +44 1225 826110, Email: s.crampin@bath.ac.uk
R. Haydock, University of Oregon, Department of Physics, 1371 E 13th Avenue, Eugene OR 97403, USA Tel: +1 541 346 5221, Fax: +1 541 346 3422, Email: haydock@darkwing.uoregon.edu
Y. Okabe, Tokyo Metropolitan University, Department of Physics, Hachioji, Tokyo 192-0397, Japan Email: okabe@phys.metro-u.ac.jp
K.M. Rabe, Rutgers University, Dept. of Physics and Astronomy, 136 Frelinghuysen, Piscataway, NJ 08854-8019, USA Tel: +1 732 445 4186, Fax: +1 732 445 4343, Email: rabe@physics.rutgers.edu
S.B. Trickey, University of Florida, QTP-Physics, Box 118440, Gainesville, FL 32611-8440, USA Tel: +1 904 392 1597, Fax: +1 904 392 8722, Email: trickey@qtp.ufl.edu
- Electromagnetics and Photonics:
- A. Bondeson, Chalmers University of Technology, Dept. of Electromagnetics, S-41296 Goteborg, Sweden Tel: +46 31 772 15 78, Fax: +46 31 772 17 25, Email: elfab@elmagn.chalmers.se
- Gravity and Astrophysics:
- H. Couchman, University of Western Ontario, Dept. of Physics and Astronomy, London ON, Canada N6A 5B7 Tel: +1 519 661 2111, Fax: +1 519 661 2033, Email: hmcouchm@julian.uwo.ca
M.L. Norman, Department of Physics, MC0424, 9500 Gilman Drive, La Jolla, CA 92093-0424, USA Tel: +1 858 822 4194, Fax: mlnorman@ucsd.edu, Email: mlnorman@uiuc.edu
E. Seidel, Max-Planck-Institut fur Gravitationsphysik, Albert-Einstein-Institut, Schlaatzweg 1, D-14473 Potsdam, Germany Tel: +49 331 27537 13, Fax: +49 331 27537 98, Email: eseidel@aei-potsdam.mpg.de
- High Energy Physics:
- A.D. Kennedy, University of Edinburgh, Maxwell Institute, King's Building, Mayfield Road, EH9 3JZ, Scotland, UK Tel: +44 131 650 5272, Fax: +44 131 650 7165, Email: adk@ph.ed.ac.uk
R.H.P. Kleiss, University of Nijmegen, Institute for Theoretical physics, P.O. Box 9010, 6500 GL Nijmegen, The Netherlands Tel: +31 24 365 3283, Fax: +31 24 365 2120, Email: kleiss@sci.kun.nl
C.B. Lang, Institut fur Theoretische Physik, Universitat splatz 5, Universitat Graz, A-8010 Graz, Austria Email: christian.lang@kfunigraz.ac.at
J. Linnemann, Department of Physics, Michigan State University, East Lansing, M1 48824-1116, USA Email: linnemann@pa.msu.edu
Y. Oyanagi, Department of Information Science, Faculty of Science, University of Tokyo, Hongo'o 7-3-1, Bankyo Ku, 113, Tokyo, Japan Email: oyanagi@is.s.u-tokyo.ac.jp
C. Rebbi, Physics Department, 590 Commonwealth Avenue, Boston, MA 02215, USA Email: rebbi@pthind.bu.edu
Z. Was, Institute of Nuclear Physics, Ul. Kawiory 26A, Krakow, Poland Email: z.was@cern.ch
- Materials Physics:
- J. Bernholc, Depertment of Physics, North Carolina State University, Box 8202, Raleigh, NC 27695, USA Email: bernholc@ncsu.edu
M. Dupuis, Pacific Northwest National Laboratory, P.O. Box 999, MS K1-83, Richland, WA 99352, USA Email: michel.dupuis@pnl.gov
E.B. Stechel, Ford Motor Company 2101 Village Road, MD 3083/SRL Room 3313, Receiving R. Bldg. R, Dearborn, MI 48121, USA
- Nuclear Physics:
- I.R. Afnan, School of Physical Sciences, The Flinders University of South Australia, G.P.O. Box 2100, Adelaide 5001, Australia Email: Iraj.Afnan@flinders.edu.au
B.S. Nilsson, Niels Bohr Institute, Blegdamsvej 17, DK-2100 Copenhagen, Denmark Email: nilsson@nbi.dk
V.R. Pandharipande, Department of Physics, University of Illinois, Lomis Laboratory of Physics, 1110 West Green Street, Urbana, IL 61801-3080, USA Email: vrp@uiuc.edu
- Plasma Physics:
- M. O'Brien, EURATOM/UKAEA Fusion Association, Culham Science Centre, Abingdon, Oxfordshire OX14 3DB, UK Email: martin.obrien@ukaea.org.uk
D.F. Duchs, Allgemeine Theorie, Max-Planck Institut fur Plasmaphysik, Postfach 1533, D-85740 Garching bei Munchen, Germany Email: duechs@IPP-garching.mpg.de
- Polymers:
- A. Balazs, Department of Materials Science and Engineering, University of Pittsburgh, Pittsburgh, PA 15261, USA Email: Toker+@pitt.edu
K. Kremer, Max-Planck-Institut fur Polymerforschung, Postfach 3148, D-55021 Mainz, Germany Email: kremer@mpip-mainz.mpg.de
P.L. Taylor, Department of Physics, Case Western Reserve University, Cleveland, OH 44106-7079, USA Email: plt@po.cwru.edu
A. Yethiraj, Department of Chemistry, University of Wisconsin, Madison, WI 53706, USA WI, USA Email: yethiraj@chem.wisc.edu
- Statistical Mechanics and Many Body Physics:
- K. Binder, Institut fur Physik, Johannes-Gutenberg-Universitat Mainz, Postfach 3980, D-55116 Mainz, Germany Email: binder@chaplin.physik.uni-mainz.de
M. Parrinello, Max-Planck-Institut fur Festkorperforschung, Heidenbergstrasse 1, Postfach 800665, D-70506 Stuttgart, Germany Email: prr@prr.mpi-stuttgart.mpg.de
- Statistics and Data Analysis:
- J. Linnemann, Department of Physics, Michigan State University, East Lansing, MI 48824-1116, USA Email: linnemann@pa.msu.edu
R. Sydora, University of Alberta, Department of Physics, Edmonton, Alberta, Canada T6G 2J1 Tel: (780) 492 3624, Email: rsydora@phys.ualberta.ca
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刊名字顺( Alphabetical List of Journals):
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